N-[3-[2-(ethylcarbamothioyl)hydrazinyl]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[2-(ethylcarbamothioyl)hydrazinyl]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-[2-(ethylcarbamothioyl)hydrazino]-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[[ethylamino(sulfanylidene)methyl]hydrazo]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-[2-(ethylcarbamothioyl)hydrazinyl]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-[N'-(ethylthiocarbamoyl)hydrazino]-3-keto-propyl]-4-nitro-benzamide Formula: C13H17N5O4S MolecularWeight: 339.37018

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC(=O)CCNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCNC(=S)NNC(=O)CCNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H17N5O4S/c1-2-14-13(23)17-16-11(19)7-8-15-12(20)9-3-5-10(6-4-9)18(21)22/h3-6H,2,7-8H2,1H3,(H,15,20)(H,16,19)(H2,14,17,23)